Phenylalanine-ochratoxin A
[CAS# 303-47-9]

Identification

• Name: Phenylalanine-ochratoxin A
• Synonyms: (R)-N-[(5-Chloro-3,4-dihydro-8-hydroxy-3-methyl-1-oxo-1H-benzo[c]pyran-7-yl)carbonyl]-3-phenylalanine; 3R,14S-Ochratoxin A; NSC 201422; NSC 221991; Phe-OTA
• Molecular Formula: C₂₀H₁₈ClNO₆
• Molecular Weight: 403.81
• CAS Registry Number: 303-47-9
• EC Number: 206-143-7

Properties

• Solubility: Insoluble (6.9E^-3 g/L) (25 °C), Calc.^*
• Density: 1.425±0.06 g/cm³ (20 °C 760 Torr), Calc.^*
• Melting point: 169 °C^**

^* Calculated using Advanced Chemistry Development (ACD/Labs) Software V11.02 (©1994-2014 ACD/Labs)

^** "Hazardous Substances Data Bank" data were obtained from the National Library of Medicine (US)

Safety Data

• Hazard Symbols: T+
• Risk Statements: R28;R40
• Safety Statements: S28;S36/37;S45

Hazard Classification

Hazard	Class	Category Code	Hazard Statement
Carcinogenicity	Carc.	2	H351
Acute toxicity	Acute Tox.	2	H300
Chronic hazardous to the aquatic environment	Aquatic Chronic	4	H413
Reproductive toxicity	Repr.	2	H361
Eye irritation	Eye Irrit.	2	H319
Acute toxicity	Acute Tox.	2	H330
Specific target organ toxicity - repeated exposure	STOT RE	2	H373
Reproductive toxicity	Lact.	-	H362
Acute toxicity	Acute Tox.	1	H300

• Transport Information: UN 3462 6.1 / PGII